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1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE is a complex chemical compound that features a purine ring with three methyl groups at positions 1, 3, and 7, and a piperazine ring at position 8. Additionally, it has a dihydro-pyrimidinedione moiety at positions 3 and 7 of the purine ring. As a derivative of the purine molecule, it holds potential in pharmaceuticals and medicinal research, particularly for the development of drugs targeting neurological and psychiatric disorders. Its unique structure and potential interactions with biological systems make it an intriguing compound for further investigation.

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  • 50693-74-8 Structure
  • Basic information

    1. Product Name: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
    2. Synonyms: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE;1,3,7-trimethyl-8-piperazin-1-ylpurine-2,6-dione
    3. CAS NO:50693-74-8
    4. Molecular Formula: C12H18N6O2
    5. Molecular Weight: 278.31
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 50693-74-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE(CAS DataBase Reference)
    10. NIST Chemistry Reference: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE(50693-74-8)
    11. EPA Substance Registry System: 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE(50693-74-8)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 50693-74-8(Hazardous Substances Data)

50693-74-8 Usage

Uses

Used in Pharmaceutical Research:
1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE is used as a research compound for the development of new drugs, specifically targeting neurological and psychiatric disorders. Its unique structure suggests potential interactions with biological systems that could be harnessed for therapeutic benefits.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE serves as a starting point for designing and synthesizing novel molecules with potential therapeutic properties. Its complex structure allows for various modifications that could lead to the discovery of effective drugs.

Check Digit Verification of cas no

The CAS Registry Mumber 50693-74-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,0,6,9 and 3 respectively; the second part has 2 digits, 7 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 50693-74:
(7*5)+(6*0)+(5*6)+(4*9)+(3*3)+(2*7)+(1*4)=128
128 % 10 = 8
So 50693-74-8 is a valid CAS Registry Number.

50693-74-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,3,7-trimethyl-8-piperazin-1-ylpurine-2,6-dione

1.2 Other means of identification

Product number -
Other names 8-piperazinocaffeine

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:50693-74-8 SDS

50693-74-8Downstream Products

50693-74-8Relevant articles and documents

Synthetic Transformations of Sesquiterpene Lactones. 11.* Conjugates Based on Caffeine and Eudesmanolides with N-Containing Linkers

Reshetnikov,Patrushev,Shults

, p. 855 - 860 (2020/09/21)

8-(Aminoalkylamino)caffeine or 8-(piperazinyl)caffeine were formed in high yields by reacting 8-bromo- or 8-chlorocaffeine with linear and cyclic diamines using microwave-assisted organic synthesis. These amines were highly reactive in Michael reactions with sesquiterpene lactones containing active methylene groups. Conjugates with caffeine and eudesmanolide moieties bonded by a N-containing linker were synthesized.

Synthesis of 8-substituted xanthines and their oxidative skeleton rearrangement to 1-oxo-2,4,7,9-tetraazaspiro[4,5]dec-2-ene-6,8,10-triones

Zimmer, Hans,Amer, Adel,Baumann, Frank M.,Haecker, Michael,Hess, Christopher G. M.,Ho, Douglas,Huber, Hans J.,Koch, Klaus,Mahnke,Schumacher, Christian,Wingfield, Robert C.

, p. 2419 - 2428 (2007/10/03)

The synthesis of a number of 8-(dialkylamino)- and 8-alkoxyxanthines (3 and 6, respectively) is described. Treatment of 3 with m-chloroperoxybenzoic acid (m-CPBA) gave by a novel rearrangement 3-(disubstituted amino)-4,7,9- trimethyl-1-oxo-2,4,7,9-tetraaz

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